Ethanone, 2-(1-methyl-2-pyrrolidinyl)-1-(2-thienyl)-
TL;DR: Ethanone, 2-(1-methyl-2-pyrrolidinyl)-1-(2-thienyl)- (CAS 76103-68-9) is a chemical compound with molecular formula C11H15NOS and molecular weight 209.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-methylpyrrolidin-2-yl)-1-thiophen-2-ylethanone
Also Known As: 2-(1-Methyl-2-pyrrolidinyl)-1-(2-thienyl)ethanone, 2-(1-methylpyrrolidin-2-yl)-1-thiophen-2-ylethanone, ETHANONE, 2-(1-METHYL-2-PYRROLIDINYL)-1-(2-THIENYL)-, 2-(1-Methylpyrrolidin-2-yl)-1-(thiophen-2-yl)ethan-1-one, RefChem:1084586
| Molecular Formula | C11H15NOS |
|---|---|
| Molecular Weight | 209.09 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 48.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 209.08743 |
| Heavy Atoms | 14 |
| Complexity | 219.0 |
Chemical Identifiers
| CAS Number | 76103-68-9 |
|---|---|
| SMILES | CN1CCCC1CC(=O)C2=CC=CS2 |
| InChIKey | HBZZDRWGYYYGLY-UHFFFAOYSA-N |
Product Overview
Ethanone, 2-(1-methyl-2-pyrrolidinyl)-1-(2-thienyl)- (CAS 76103-68-9), with molecular formula C11H15NOS and molecular weight 209.09 g/mol. IUPAC: 2-(1-methylpyrrolidin-2-yl)-1-thiophen-2-ylethanone.
Chemical Property Profile of Ethanone, 2-(1-methyl-2-pyrrolidinyl)-1-(2-thienyl)-
Property Insights of Ethanone, 2-(1-methyl-2-pyrrolidinyl)-1-(2-thienyl)-
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanone, 2-(1-methyl-2-pyrrolidinyl)-1-(2-thienyl)-. With a topological polar surface area (TPSA) of 48.6 Ų, Ethanone, 2-(1-methyl-2-pyrrolidinyl)-1-(2-thienyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethanone, 2-(1-methyl-2-pyrrolidinyl)-1-(2-thienyl)- has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ethanone, 2-(1-methyl-2-pyrrolidinyl)-1-(2-thienyl)-?
The CAS number of Ethanone, 2-(1-methyl-2-pyrrolidinyl)-1-(2-thienyl)- is 76103-68-9.
What is the molecular formula of Ethanone, 2-(1-methyl-2-pyrrolidinyl)-1-(2-thienyl)-?
The molecular formula of Ethanone, 2-(1-methyl-2-pyrrolidinyl)-1-(2-thienyl)- is C11H15NOS.
What is the molecular weight of Ethanone, 2-(1-methyl-2-pyrrolidinyl)-1-(2-thienyl)-?
The molecular weight of Ethanone, 2-(1-methyl-2-pyrrolidinyl)-1-(2-thienyl)- is 209.09 g/mol.
Where can I buy Ethanone, 2-(1-methyl-2-pyrrolidinyl)-1-(2-thienyl)-?
You can request a quote for Ethanone, 2-(1-methyl-2-pyrrolidinyl)-1-(2-thienyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanone, 2-(1-methyl-2-pyrrolidinyl)-1-(2-thienyl)-?
Yes, KEHONG BIO provides custom synthesis services for Ethanone, 2-(1-methyl-2-pyrrolidinyl)-1-(2-thienyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.